Geometry & MOs

Info

ID:	412533
PubChem CID:	135085428
Reduced:	NiN6C19H20 (1)
Stoich.:	AB6C19D20 (1)
Weight, g/mol:	341.295985
ΔH_f, kcal/mol:	174.7
Dipole, Da:	4.29
IP(EA), eV:	-7.13(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-2,8,9-tris(2-methylpropyl)-2,8,9-triaza-1-phosphabicyclo[3.3.2]decane

Drug info:

PubChemData

Smile

[CH-]1N(C=CN1CN2[CH-]N(C=C2)CC3=CC=CC=N3)CC4=CC=CC=N4.[Ni+2]

DOS

IR

Vibrations